SCHEMBL7363385

SCHEMBL7363385

Fc1ccc(SCC2CCN(CC3CC3)CC2)cc1

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.54
HTR2A P28223 3/20 0.54
HTR2C P28335 2/20 0.54
HTR2B P41595 2/20 0.54
SIGMAR1 Q99720 2/20 0.54
CRBN Q96SW2 1/20 0.41
HTR1A P08908 1/20 0.41
DRD3 P35462 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21820657 0.78 CRBN (0.49) CRBN
SCHEMBL4777512 0.76 ALDH1A1 (0.44) DRD2HTR2AHTR2CHTR2BSIGMAR1
Hydrochloric Acid SCHEMBL4771613 0.75 ALDH1A1 (0.43) CRBN
SCHEMBL7326912 0.73 SIGMAR1 (0.52) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL7362469 0.72 SIGMAR1 (0.71) SIGMAR1
SCHEMBL5549969 0.71 CRBN (0.43) DRD2HTR2AHTR2CHTR2BCRBN
Hydrochloric Acid SCHEMBL7356651 0.71 SIGMAR1 (0.69) SIGMAR1
SCHEMBL7356760 0.71 DRD2 (0.56) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL15305255 0.70 TRPA1 (0.59) DRD2HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL7358161 0.70 DRD2 (0.51) DRD2HTR2AHTR2CHTR2BSIGMAR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5296479-A Treating physiological or drug-induced psychosis or dyskinesia THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-03-22 US disclosed
US-5266572-A Antipsychotic 1-cycloalkylpiperidines THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-11-30 US disclosed
US-5243048-A Treatment of drug-induced or physiological psychosis or dyskinesia; side effect reduction THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-09-07 US disclosed
EP-0490962-A4 ANTIPSYCHOTIC 1-CYCLOALKYLPIPERIDINES 1993-03-03 EP disclosed
EP-0490962-A1 ANTIPSYCHOTIC 1-CYCLOALKYLPIPERIDINES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-06-24 EP disclosed
US-5109002-A ANTIPSYCHOTIC 1-CYCLOALKYLPIPERIDINES DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-04-28 US disclosed
WO-1991003243-A1 ANTIPSYCHOTIC 1-CYCLOALKYLPIPERIDINES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1991-03-21 WO disclosed